COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK856394
Chemical Name: 3-(4-chlorophenyl)-1-(3-hydroxypropyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: OCCCN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)Cl

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Molecular Weight: 402.84
Empirical Formula: C18H19ClN6O3

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 1.615
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 94
Number of rings: 4

     

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